Compound Identification
SMILES
CCOC1=C(OC)C=C(C=C1)C1N(C(=O)C(=O)C1=C(O)C1=CC=NC=C1)C1=NN=C(SCC2=C(Cl)C=C(Cl)C=C2)S1
InChIKey
InChIKey=XMMTUYAMVRDQQO-UHFFFAOYSA-N
Formula
C28H22Cl2N4O5S2
Mass
629.53
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Anisoles Dichlorobenzenes Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Alkylarylthioethers Aryl chlorides Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridines and derivatives Thiadiazoles Heteroaromatic compounds Tertiary carboxylic acid amides Vinylogous acids Pyrroles Lactams Cyclic ketones Enols Sulfenyl compounds Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Anisole - 1,3-dichlorobenzene - Phenol ether - Methoxybenzene - Aryl thioether - Phenoxy compound - Chlorobenzene - Alkyl aryl ether - Alkylarylthioether - Halobenzene - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Pyridine - Pyrrolidone - 3-pyrrolidone - 2-pyrrolidone - Tertiary carboxylic acid amide - Pyrrole - Thiadiazole - Heteroaromatic compound - Vinylogous acid - Azole - Carboxamide group - Cyclic ketone - Ketone - Lactam - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Enol - Ether - Organosulfur compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available